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76771

cis,cis-9,12-Octadecadienoyl-L-carnitine

analytical standard

Synonym(s):

(2R)-3-Carboxy-N,N,N-trimethyl-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]-1-propanaminium inner salt, Linoleoyl-L-carnitine

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About This Item

Empirical Formula (Hill Notation):
C25H45NO4
CAS Number:
36816-10-1
Molecular Weight:
423.63
MDL number:
MFCD24386432
UNSPSC Code:
12352211
NACRES:
NB.21
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grade

analytical standard

Quality Segment

100

assay

≥95.0% (LC/MS)

optical activity

[α]/D -13±2°, c = 0.1 in methanol

shelf life

limited shelf life, expiry date on the label

application(s)

clinical testing

format

neat

storage temp.

−20°C

SMILES string

[N+](C[C@H](OC(=O)CCCCCCC\C=C/C\C=C/CCCCC)CC(=O)[O-])(C)(C)C

InChI

1S/C25H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h9-10,12-13,23H,5-8,11,14-22H2,1-4H3/b10-9-,13-12-/t23-/m1/s1

InChI key

MJLXQSQYKZWZCB-DQFWFXSYSA-N

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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